4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide

C6H7N7O — CID 606239

IUPAC4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide
SMILESNNC(=O)c1nnc2ccnn2c1N
InChIInChI=1S/C6H7N7O/c7-5-4(6(14)10-8)12-11-3-1-2-9-13(3)5/h1-2H,7-8H2,(H,10,14)
InChIKeyJVUHKCVXEKCLAH-UHFFFAOYSA-N
MW193.17 g/mol
LogP-1.69
Rot. Bonds1

About 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide

4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide (PubChem CID 606239) has the molecular formula C6H7N7O and a molecular weight of 193.17 g/mol. Its IUPAC name is 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide.

Molecular Properties

Compound Name4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide
PubChem CID606239
Molecular FormulaC6H7N7O
Molecular Weight193.17 g/mol
Exact Mass193.07
IUPAC Name4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide
SMILESNNC(=O)c1nnc2ccnn2c1N
InChIInChI=1S/C6H7N7O/c7-5-4(6(14)10-8)12-11-3-1-2-9-13(3)5/h1-2H,7-8H2,(H,10,14)
InChIKeyJVUHKCVXEKCLAH-UHFFFAOYSA-N
XLogP-1.69
TPSA124.22 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.17
LogP ≤ 5-1.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide?
The IUPAC name of 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide (CID 606239) is 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide.
What is the SMILES notation for 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide?
The canonical SMILES for 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide is NNC(=O)c1nnc2ccnn2c1N.
What is the InChIKey of 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide?
The InChIKey is JVUHKCVXEKCLAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N7O/c7-5-4(6(14)10-8)12-11-3-1-2-9-13(3)5/h1-2H,7-8H2,(H,10,14).
What are the key properties of 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide?
4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide has a molecular weight of 193.17 g/mol, XLogP of -1.69, 1 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide is sourced from PubChem (CID 606239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).